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Detecting Drug Promiscuity Using Gaussian Ensemble Screening

Published:2012-07-19 Issue:8 Volume:52 Page:1948-1961
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Pérez-Nueno Violeta I.¹,Venkatraman Vishwesh¹,Mavridis Lazaros¹,Ritchie David W.¹

Affiliation:

1. INRIA Nancy − Grand Est, 615 rue du Jardin Botanique, 54506 Vandoeuvre-lès-Nancy, France

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ci3000979

Reference90 articles.

1. Structure-based systems biology for analyzing off-target binding

2. Selective Optimization of Side Activities: Another Way for Drug Discovery

3. The Chemical Basis of Pharmacology

4. Modeling Promiscuity Based on in vitro Safety Pharmacology Profiling Data

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